Geometry & MOs

Info

ID:	250007
PubChem CID:	103093480
Reduced:	NSC12H19 (1)
Stoich.:	ABC12D19 (1)
Weight, g/mol:	275.224915
ΔH_f, kcal/mol:	8.62
Dipole, Da:	0.62
IP(EA), eV:	-8.91(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-ethyl-3-methyl-4-(4-pentoxyphenyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C(=C/C1=CC=C(S1)C)/C

DOS

IR

Vibrations