Geometry & MOs

Info

ID:	275855
PubChem CID:	103818475
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-111.3
Dipole, Da:	2.44
IP(EA), eV:	-7.88(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=CC=C(C=C1)NCC2=CC=CC=C2O

DOS

IR

Vibrations