Geometry & MOs

Info

ID:	429219
PubChem CID:	135169123
Reduced:	O3N5C26H27 (1)
Stoich.:	A3B5C26D27 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-28.33
Dipole, Da:	3.74
IP(EA), eV:	-9.19(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(4-ethylpyridin-2-yl)-N-[(4-methoxyphenyl)methyl]carbamate

Drug info:

PubChemData

Smile

CC[C@H](C1=CN=CC=C1)NC(=O)N2[C@@H](C(C2=O)CC3=CC=NC=C3)C(=O)N(C)C4=CC=CC=C4

DOS

IR

Vibrations